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CAS Number: 756486-14-3
(S)-1-tert-butyl 2-methyl 4-oxopiperidine-1,2-dicarboxylate

Structure

(S)-1-tert-butyl 2-methyl 4-oxopiperidine-1,2-dicarboxylate
Name: (S)-1-tert-butyl 2-methyl 4-oxopiperidine-1,2-dicarboxylate
Synonyms:
General Information
Product Number: 756486143
CAS Registry Number: 756486-14-3
Name:
1,​2-​Piperidinedicarboxyl​ic acid, 4-​oxo-​, 1-​(1,​1-​dimethylethyl) 2-​methyl ester, (2S)​-
 
Chemical Formula: C12H19NO5
Exact Mass: 257.13
Molecular Weight: 257.28
m/z: 257.13 (100.0%), 258.13 (13.4%), 259.13 (1.9%)
Elemental Analysis: C, 56.02; H, 7.44; N, 5.44; O, 31.09
 
InChI: InChI=1S/C12H19NO5/c1-12(2,3)18-11(16)13-6-5-8(14)7-9(13)10(15)17-4/h9H,5-7H2,1-4H3/t9-/m0/s1
InChIKey: ROHLQPZIUYTLGR-VIFPVBQESA-N
Canonical SMILES : CC(C)(C)OC(=O)N1CCC(=O)CC1C(=O)OC
Isomeric SMILES: CC(C)(C)OC(=O)N1CCC(=O)C[C@H]1C(=O)OC

Specification

98%

References
  1. (1) Lewis, Jason G.; WO 2005012320 A2 2005 CAPLUS
  2. (2) Lewis, Jason G.; US 20050043248 A1 2005 CAPLUS
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